REMARK  Name = LIG001087
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.411   1.950  -0.240  0.00  0.00    +0.059 A 
ATOM      2  N   LIG    1        1.503   1.103  -0.381  0.00  0.00    -0.229 NA
ATOM      3  C   LIG    1        2.609   1.779  -0.606  0.00  0.00    +0.164 A 
ATOM      4  S   LIG    1        2.379   3.493  -0.686  0.00  0.00    -0.060 S 
ATOM      5  C   LIG    1        0.708   3.290  -0.396  0.00  0.00    +0.072 A 
ENDROOT
BRANCH   3   6
ATOM      6  N   LIG    1        3.849   1.286  -0.780  0.00  0.00    -0.279 N 
ATOM      7  H   LIG    1        4.614   1.927  -0.947  0.00  0.00    +0.155 HD
BRANCH   6   8
ATOM      8  C   LIG    1        4.315  -0.022  -0.764  0.00  0.00    +0.127 A 
ATOM      9  N   LIG    1        5.644  -0.144  -0.978  0.00  0.00    -0.204 NA
ATOM     10  C   LIG    1        6.172  -1.386  -0.977  0.00  0.00    +0.215 A 
ATOM     11  F   LIG    1        7.492  -1.494  -1.191  0.00  0.00    -0.184 F 
ATOM     12  C   LIG    1        5.446  -2.542  -0.772  0.00  0.00    +0.059 A 
ATOM     13  C   LIG    1        4.085  -2.416  -0.554  0.00  0.00    +0.008 A 
ATOM     14  C   LIG    1        3.514  -1.142  -0.549  0.00  0.00    +0.044 A 
ENDBRANCH   6   8
ENDBRANCH   3   6
BRANCH   1  15
ATOM     15  C   LIG    1       -0.938   1.347   0.007  0.00  0.00    +0.152 C 
BRANCH  15  18
ATOM     16  N   LIG    1       -2.731   1.218   1.749  0.00  0.00    -0.264 N 
ATOM     17  H   LIG    1       -3.072   1.528   2.647  0.00  0.00    +0.157 HD
ATOM     18  C   LIG    1       -1.554   1.772   1.334  0.00  0.00    +0.224 C 
ATOM     19  O   LIG    1       -1.046   2.623   2.071  0.00  0.00    -0.275 OA
BRANCH  16  23
ATOM     20  C   LIG    1       -6.550  -1.983   0.534  0.00  0.00    +0.053 C 
ATOM     21  C   LIG    1       -5.313  -1.162   0.534  0.00  0.00    +0.008 A 
ATOM     22  S   LIG    1       -4.912  -0.163   1.871  0.00  0.00    -0.057 S 
ATOM     23  C   LIG    1       -3.495   0.327   1.057  0.00  0.00    +0.165 A 
ATOM     24  N   LIG    1       -3.295  -0.183  -0.129  0.00  0.00    -0.233 NA
ATOM     25  C   LIG    1       -4.335  -1.042  -0.433  0.00  0.00    +0.124 A 
ENDBRANCH  16  23
ENDBRANCH  15  18
ENDBRANCH   1  15
TORSDOF 5